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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H19NO2S
Molecular Weight 313.414
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-HYDROXYDULOXETINE

SMILES

CNCC[C@H](OC1=C2C=CC=C(O)C2=CC=C1)C3=CC=CS3

InChI

InChIKey=MBVKPOXXMWDHKB-KRWDZBQOSA-N
InChI=1S/C18H19NO2S/c1-19-11-10-17(18-9-4-12-22-18)21-16-8-3-5-13-14(16)6-2-7-15(13)20/h2-9,12,17,19-20H,10-11H2,1H3/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H19NO2S
Molecular Weight 313.414
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:01:09 GMT 2023
Edited
by admin
on Sat Dec 16 01:01:09 GMT 2023
Record UNII
24CAA38X5F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-HYDROXYDULOXETINE
Common Name English
5-HYDROXY DULOXETINE
Common Name English
1-NAPHTHALENOL, 5-((1S)-3-(METHYLAMINO)-1-(2-THIENYL)PROPOXY)-
Systematic Name English
4-HYDROXY DULOXETINE
Common Name English
Code System Code Type Description
CAS
741693-77-6
Created by admin on Sat Dec 16 01:01:09 GMT 2023 , Edited by admin on Sat Dec 16 01:01:09 GMT 2023
PRIMARY
EPA CompTox
DTXSID40225134
Created by admin on Sat Dec 16 01:01:09 GMT 2023 , Edited by admin on Sat Dec 16 01:01:09 GMT 2023
PRIMARY
FDA UNII
24CAA38X5F
Created by admin on Sat Dec 16 01:01:09 GMT 2023 , Edited by admin on Sat Dec 16 01:01:09 GMT 2023
PRIMARY
PUBCHEM
44344235
Created by admin on Sat Dec 16 01:01:09 GMT 2023 , Edited by admin on Sat Dec 16 01:01:09 GMT 2023
PRIMARY
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